Catalogue Number
BN-O0048
Analysis Method
HPLC,NMR,MS
Specification
98%(HPLC)
Storage
-20℃
Molecular Weight
248.36
Appearance
Powder
Botanical Source
This product is isolated and purified from the herbs of Sophora alopecuroides L.
Structure Type
Alkaloids
Category
Standards;Natural Pytochemical;API
SMILES
C1CC2C3CCCN4C3C(CCC4)CN2C(=O)C1
Synonyms
13S-HYDROXY-6Z,9Z,11E-OCTADECATRIENOIC ACID/4-(2-Biphenylyl)-1-(hydroxymethyl)-10-oxa-4-azatricyclo[5.2.1.0]dec-8-ene-3,5-dione/13-hydroxy-(6Z,9Z,11E,13S)-6,9,11-octadecatrienoic acid/13(S)-HYDROXY-9(Z),11(E),15(Z)-OCTADECATRIENOIC ACID/(13S,6Z,9Z,11E)-hydroxyoctadeca-6,9,11-trienoic acid/Allomatrine/13-hydroxy-6,9,11-octadecatrienoic acid/4,7-Epoxy-1H-isoindole-1,3(2H)-dione, 2-[1,1'-biphenyl]-2-yl-3a,4,7,7a-tetrahydro-4-(hydroxymethyl)-/(+)-Allomatrin/13(S)-HOT/13(S)-HYDROXYOCTADECA-6Z,9Z,11E-TRIENOIC ACID/13(S)-HOTE/(6Z,9Z,11E)-13(S)-hydroxyoctadeca-6,9,11-trienoic acid
IUPAC Name
(1R,2R,9S,17R)-7,13-diazatetracyclo[7.7.1.02,7.013,17]heptadecan-6-one
Density
1.4±0.1 g/cm3
Solubility
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
Flash Point
340.1±31.5 °C
Boiling Point
638.7±55.0 °C at 760 mmHg
Melting Point
106-107 a„ƒ
InChl
InChl Key
ZSBXGIUJOOQZMP-KYEXWDHISA-N
WGK Germany
RID/ADR
HS Code Reference
2933990000
Personal Projective Equipment
Correct Usage
For Reference Standard and R&D, Not for Human Use Directly.
Meta Tag
provides coniferyl ferulate(CAS#:641-39-4) MSDS, density, melting point, boiling point, structure, formula, molecular weight etc. Articles of coniferyl ferulate are included as well.>> amp version: coniferyl ferulate
No Technical Documents Available For This Product.
30344490
Objectives: The purpose of this study is to investigate the anti-inflammatory activity of a hexa-herbal Chinese formula (HHCF) using spontaneously immortalized human epidermal keratinocytes (HaCaT) and to predict the active components by correlating the LC-MS-based metabolite profiles of the HHCF and its 12 varied formulae with their anti-inflammatory activity using partial least-squares regression analysis.
Methods: The HHCF comprises the rootstock of Scutellaria baicalensis, Rheum tanguticum, Sophora flavescens, the root bark of Dictamnus dasycarpus, the bark of Phellodendron chinense, and the fruit of Kochia scoparia in equal proportions. Its 12 varied formulae were developed by uniform design with varied proportions of the component botanical drugs. The decoctions of the HHCF and its 12 varied formulae were profiled using liquid chromatography (LC) combined with triple quadrupole mass spectrometry (MS) and their effects on tumor necrosis factor (TNF)-α -plus-interferon (IFN)-γ-induced C-C motif chemokine ligand 17 (CCL17) production in HaCaT were investigated. Partial least-squares regression analysis was conducted to assess the relationship between the LC-MS-based metabolite profiles of the decoctions to anti-CCL17 production in HaCaT.
Results: Compounds with potential to promote anti-CCL17 production in HaCaT were identified (e.g., berberine, pyrogallol and catechin dimers) as a result of the developed model and their potential to act as anti-inflammatory agents were also supported by relevant literature.
Conclusion: This promising approach should assist in the screening process of active components from complex Chinese herbal preparations and will better inform the necessary pharmacological experiments to take forward.
CCL17, Chinese herbal medicine formula, chemometric, HaCaT, inflammation, LC-MS-based metabolite profiles, partial least-squares regression
Disentangling the Complexity of a Hexa-Herbal Chinese Medicine Used for Inflammatory Skin Conditions—Predicting the Active Components by Combining LC-MS-Based Metabolite Profiles and in vitro Pharmacology
Jennifer B. Chang, Majella E. Lane, Min Yang, Michael Heinrich
2018;